1-(4-chlorophenyl)-4-nitro-butan-1-one

Systemtic Name: 1-(4-chlorophenyl)-4-nitro-butan-1-one Openeye Name: 1-(4-chlorophenyl)-4-nitro-butan-1-one CAS Name: 1-(4-chlorophenyl)-4-nitro-1-butanone IUPAC Name: 1-(4-chlorophenyl)-4-nitrobutan-1-one Traditional Name: 1-(4-chlorophenyl)-4-nitro-butan-1-one Formula: C10H10ClNO3 MolecularWeight: 227.6443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCC[N+](=O)[O-])Cl

InChI

InChI=1S/C10H10ClNO3/c11-9-5-3-8(4-6-9)10(13)2-1-7-12(14)15/h3-6H,1-2,7H2